(3S,4S)-N-[(Z)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-2-oxidanylidene-4-phenyl-pyrrolidine-3-carboxamide

Systemtic Name: (3S,4S)-N-[(Z)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-2-oxidanylidene-4-phenyl-pyrrolidine-3-carboxamide Openeye Name: (3S,4S)-N-[(Z)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-2-oxo-4-phenyl-pyrrolidine-3-carboxamide CAS Name: (3S,4S)-N-[(Z)-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylideneamino]-2-oxo-4-phenyl-3-pyrrolidinecarboxamide IUPAC Name: (3S,4S)-N-[(Z)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-2-oxo-4-phenylpyrrolidine-3-carboxamide Traditional Name: (3S,4S)-N-[(Z)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-2-keto-4-phenyl-pyrrolidine-3-carboxamide Formula: C22H20ClN5O2 MolecularWeight: 421.8795

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=O)C2C(CNC2=O)C3=CC=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=N\NC(=O)[C@H]2[C@H](CNC2=O)C3=CC=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H20ClN5O2/c1-14-17(20(23)28(27-14)16-10-6-3-7-11-16)13-25-26-22(30)19-18(12-24-21(19)29)15-8-4-2-5-9-15/h2-11,13,18-19H,12H2,1H3,(H,24,29)(H,26,30)/b25-13-/t18-,19+/m1/s1